/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner 
/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner
Ne
fcc
LJ_Shifted_Bernardes_1958HighCutoff_Ne__MO_966254629593_004
4.226186460256581e-10
4.230948643959036e-21